N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide

C9H10FN3O5S — CID 82920985

IUPACN-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide
SMILESNC(=O)NC(=O)COc1ccc(S(N)(=O)=O)cc1F
InChIInChI=1S/C9H10FN3O5S/c10-6-3-5(19(12,16)17)1-2-7(6)18-4-8(14)13-9(11)15/h1-3H,4H2,(H2,12,16,17)(H3,11,13,14,15)
InChIKeyPXZOGAURWJAZMB-UHFFFAOYSA-N
MW291.26 g/mol
LogP-0.95
Rot. Bonds4

About N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide

N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide (PubChem CID 82920985) has the molecular formula C9H10FN3O5S and a molecular weight of 291.26 g/mol. Its IUPAC name is N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide
PubChem CID82920985
Molecular FormulaC9H10FN3O5S
Molecular Weight291.26 g/mol
Exact Mass291.03
IUPAC NameN-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide
SMILESNC(=O)NC(=O)COc1ccc(S(N)(=O)=O)cc1F
InChIInChI=1S/C9H10FN3O5S/c10-6-3-5(19(12,16)17)1-2-7(6)18-4-8(14)13-9(11)15/h1-3H,4H2,(H2,12,16,17)(H3,11,13,14,15)
InChIKeyPXZOGAURWJAZMB-UHFFFAOYSA-N
XLogP-0.95
TPSA141.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.26
LogP ≤ 5-0.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-carbamoyl-2-[4-(ethylaminomethyl)-2-fluorophenoxy]acetamide
CID 107687126
4-ethoxy-3-fluorobenzenesulfonamide
CID 43164444
4-[2-(carbamoylamino)-2-oxoethoxy]-3-chlorobenzenesulfonyl chloride
CID 82916908
3-fluoro-4-(3-methylbut-2-enoxy)benzenesulfonamide
CID 82921786
2-[2-(carbamoylamino)-2-oxoethoxy]-5-chlorobenzenesulfonyl chloride
CID 82920933
3-fluoro-4-(3-fluoropropoxy)benzenesulfonamide
CID 81113749
4-(2-ethoxyethoxy)-3-fluorobenzenesulfonamide
CID 43457341
4-[2-(carbamoylamino)-2-oxoethoxy]-2,3-difluorobenzenesulfonyl chloride
CID 82920937
3-fluoro-4-(2-propan-2-yloxyethoxy)benzenesulfonamide
CID 61485134
4-[2-(ethylamino)-2-oxoethoxy]-3-fluorobenzenesulfonyl chloride
CID 82917384
4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide
CID 82921210
2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide
CID 82915001

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide?
The IUPAC name of N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide (CID 82920985) is N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide.
What is the SMILES notation for N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide?
The canonical SMILES for N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide is NC(=O)NC(=O)COc1ccc(S(N)(=O)=O)cc1F.
What is the InChIKey of N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide?
The InChIKey is PXZOGAURWJAZMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN3O5S/c10-6-3-5(19(12,16)17)1-2-7(6)18-4-8(14)13-9(11)15/h1-3H,4H2,(H2,12,16,17)(H3,11,13,14,15).
What are the key properties of N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide?
N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide has a molecular weight of 291.26 g/mol, XLogP of -0.95, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide is sourced from PubChem (CID 82920985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).